Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | BUB1 | O43683 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | ITK | Q08881 | 2/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.32 |
| ▸ | CDK9 | P50750 | 2/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.32 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL18352379 | 0.88 | SCN9A (0.40) | SCN9AAXLBUB1BRD4MKNK2 | |
| SCHEMBL30092492 | 0.85 | SCN9A (0.38) | SCN9AAXLBUB1BRD4MKNK2 | |
| SCHEMBL16935982 | 0.85 | SCN9A (0.38) | SCN9AAXLBUB1BRD4MKNK2 | |
| SCHEMBL18352908 | 0.75 | KDM4E (0.39) | MKNK2MKNK1TGFBR1NTRK1 | |
| SCHEMBL16935925 | 0.74 | SCN9A (0.46) | SCN9AAXLBRD4CA12CA1 | |
| SCHEMBL16947094 | 0.73 | AAK1 (0.37) | MKNK1TGFBR1PDK2 | |
| SCHEMBL18353076 | 0.73 | AAK1 (0.37) | MKNK1TGFBR1PDK2 | |
| SCHEMBL16946787 | 0.73 | SCN9A (0.48) | SCN9AAXLBRD4EGFRITK | |
| SCHEMBL23000217 | 0.71 | CA1 (0.44) | SCN9AAXLBRD4MKNK2CA12 | |
| SCHEMBL23000220 | 0.71 | CA1 (0.44) | SCN9AAXLBRD4MKNK2CA12 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3636649-A1 | DIARYL MACROCYCLES AS MODULATORS OF PROTEIN KINASES | Turning Point Therapeutics, Inc. (US) | 2020-04-15 | — | — | EP | disclosed |
| EP-3636650-A1 | DIARYL MACROCYCLES AS MODULATORS OF PROTEIN KINASES | Turning Point Therapeutics, Inc. (US) | 2020-04-15 | — | — | EP | disclosed |